5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine

C10H5Cl2N5 — CID 81441444

IUPAC5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine
SMILESClc1cnccc1-c1nnc2cncc(Cl)n12
InChIInChI=1S/C10H5Cl2N5/c11-7-3-13-2-1-6(7)10-16-15-9-5-14-4-8(12)17(9)10/h1-5H
InChIKeySAQYAXRZFKMSBB-UHFFFAOYSA-N
MW266.09 g/mol
LogP2.49
Rot. Bonds1

About 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine

5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 81441444) has the molecular formula C10H5Cl2N5 and a molecular weight of 266.09 g/mol. Its IUPAC name is 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

Compound Name5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine
PubChem CID81441444
Molecular FormulaC10H5Cl2N5
Molecular Weight266.09 g/mol
Exact Mass264.99
IUPAC Name5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine
SMILESClc1cnccc1-c1nnc2cncc(Cl)n12
InChIInChI=1S/C10H5Cl2N5/c11-7-3-13-2-1-6(7)10-16-15-9-5-14-4-8(12)17(9)10/h1-5H
InChIKeySAQYAXRZFKMSBB-UHFFFAOYSA-N
XLogP2.49
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.09
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine?
The IUPAC name of 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine (CID 81441444) is 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine.
What is the SMILES notation for 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine?
The canonical SMILES for 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine is Clc1cnccc1-c1nnc2cncc(Cl)n12.
What is the InChIKey of 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine?
The InChIKey is SAQYAXRZFKMSBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2N5/c11-7-3-13-2-1-6(7)10-16-15-9-5-14-4-8(12)17(9)10/h1-5H.
What are the key properties of 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine?
5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 266.09 g/mol, XLogP of 2.49, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(3-chloro-4-pyridinyl)-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 81441444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).